Phenyl trichlorosilane

• Formula: C₆H₅Cl₃Si
• Molecular weight: 211.548
• IUPAC Standard InChI: InChI=1S/C6H5Cl3Si/c7-10(8,9)6-4-2-1-3-5-6/h1-5H Copy

  
• IUPAC Standard InChIKey: ORVMIVQULIKXCP-UHFFFAOYSA-N Copy
• CAS Registry Number: 98-13-5
• Chemical structure:
  This structure is also available as a 2d Mol file
• Other names: Trichlorophenylsilane; Silane, trichlorophenyl-; Phenylsilicon trichloride; Silane, phenyltrichloro-; Silicon phenyl trichloride; UN 1804; CP0280
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• Information on this page:
  • Phase change data
  • Gas phase ion energetics data
  • IR Spectrum
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Condensed phase thermochemistry data
  • Mass spectrum (electron ionization)
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Phase change data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing

Enthalpy of vaporization

Antoine Equation Parameters

log₁₀(P) = A − (B / (T + C))
    P = vapor pressure (bar)
    T = temperature (K)

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Enthalpy of fusion

Entropy of fusion

Gas phase ion energetics data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard

Ionization energy determinations

IR Spectrum

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Coblentz Society, Inc.

Condensed Phase Spectrum

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Notice: Except where noted, spectra from this collection were measured on dispersive instruments, often in carefully selected solvents, and hence may differ in detail from measurements on FTIR instruments or in other chemical environments. More information on the manner in which spectra in this collection were collected can be found here.

Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.

Additional Data

Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

PCR Inc., 1990
PCR Inc., Research Chemicals Catalog 1990-1991, PCR Inc., Gainesville, FL, 1990, 1. [all data]

Gumbatov and Kostryukov, 1965
Gumbatov, D.O.; Kostryukov, V.N., Thermodynamic studies at low temperatures. The specific heat, entropy, enthalpy, and internal rotation potential of C6H5SiCl3, Zh. Fiz. Khim., 1965, 39, 116-22. [all data]

Sokolov, Karapet'yants, et al., 1970
Sokolov, V.B.; Karapet'yants, M.Kh.; Goncharov, A.K., Tr. Mosk. Khim. Tekhnol. Inst., 1970, 67, 37. [all data]

Jenkins and Chambers, 1954
Jenkins, Arthur C.; Chambers, George F., Vapor Pressures of Silicon Compounds, Ind. Eng. Chem., 1954, 46, 11, 2367-2369, https://doi.org/10.1021/ie50539a043 . [all data]

Gumbatov and Kostrykov, 1965
Gumbatov, D.O.; Kostrykov, V.N., Thermodynamic studies at low temperatures. The specific heat, entropy, enthalpy, and internal rotation potential of C₆H₅SiCl₃, Zhur. Fiz. Khim., 1965, 39, 116-122. [all data]

Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D., Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III, J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985 . [all data]

Veszpremi, Harada, et al., 1984
Veszpremi, T.; Harada, Y.; Ohno, K.; Mutoh, H., Jr., Photoelectron and penning electron spectroscopic investigation of phenylhalosilanes, J. Organomet. Chem., 1984, 266, 9. [all data]

Ainshtein and Shulyatieva, 1972
Ainshtein, A.A.; Shulyatieva, T.I., Retention indices of alkyl- and arylchlorosilanes, Zh. Anal. Khim., 1972, 27, 816-821. [all data]

Notes

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• Symbols used in this document:
  

  Tboil	Boiling point
  Ttriple	Triple point temperature
  ΔfusH	Enthalpy of fusion
  ΔfusS	Entropy of fusion
  ΔvapH	Enthalpy of vaporization

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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